N-hexan-2-yl-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline

Systemtic Name: N-hexan-2-yl-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Openeye Name: N-(1-methylpentyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline CAS Name: N-hexan-2-yl-4-(1H-1,2,4-triazol-5-ylthio)aniline IUPAC Name: N-hexan-2-yl-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Traditional Name: 1-methylpentyl-[4-(1H-1,2,4-triazol-5-ylthio)phenyl]amine Formula: C14H20N4S MolecularWeight: 276.4004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)NC1=CC=C(C=C1)SC2=NC=NN2

Isomeric SMILES

CCCCC(C)NC1=CC=C(C=C1)SC2=NC=NN2

InChI

InChI=1S/C14H20N4S/c1-3-4-5-11(2)17-12-6-8-13(9-7-12)19-14-15-10-16-18-14/h6-11,17H,3-5H2,1-2H3,(H,15,16,18)